2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide

C24H21NO4 — CID 4022781

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
SMILESCOc1cc2c(cc1NC(=O)COc1ccc3c(c1)CCC3)oc1ccccc12
InChIInChI=1S/C24H21NO4/c1-27-23-12-19-18-7-2-3-8-21(18)29-22(19)13-20(23)25-24(26)14-28-17-10-9-15-5-4-6-16(15)11-17/h2-3,7-13H,4-6,14H2,1H3,(H,25,26)
InChIKeyIPYBUDIGRGRLRZ-UHFFFAOYSA-N
MW387.44 g/mol
LogP5.10
Rot. Bonds5

About 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide

2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide (PubChem CID 4022781) has the molecular formula C24H21NO4 and a molecular weight of 387.44 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
PubChem CID4022781
Molecular FormulaC24H21NO4
Molecular Weight387.44 g/mol
Exact Mass387.15
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide
SMILESCOc1cc2c(cc1NC(=O)COc1ccc3c(c1)CCC3)oc1ccccc12
InChIInChI=1S/C24H21NO4/c1-27-23-12-19-18-7-2-3-8-21(18)29-22(19)13-20(23)25-24(26)14-28-17-10-9-15-5-4-6-16(15)11-17/h2-3,7-13H,4-6,14H2,1H3,(H,25,26)
InChIKeyIPYBUDIGRGRLRZ-UHFFFAOYSA-N
XLogP5.10
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.44
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide (CID 4022781) is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide is COc1cc2c(cc1NC(=O)COc1ccc3c(c1)CCC3)oc1ccccc12.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
The InChIKey is IPYBUDIGRGRLRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NO4/c1-27-23-12-19-18-7-2-3-8-21(18)29-22(19)13-20(23)25-24(26)14-28-17-10-9-15-5-4-6-16(15)11-17/h2-3,7-13H,4-6,14H2,1H3,(H,25,26).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide?
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide has a molecular weight of 387.44 g/mol, XLogP of 5.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-methoxydibenzofuran-3-yl)acetamide is sourced from PubChem (CID 4022781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).